Found 517 results

Search term: MF = 'C_{11}H_{18}O_{4}S'
ChemSpider 2D Image | Diethyl (1-sulfanylbutylidene)malonate | C11H18O4S

Diethyl (1-sulfanylbutylidene)malonate

  • Molecular FormulaC11H18O4S
  • Average mass246.323 Da
  • Monoisotopic mass246.092575 Da
  • ChemSpider ID28704400

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1-Sulfanylbutylidène)malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl (1-sulfanylbutylidene)malonate [ACD/IUPAC Name]
Diethyl-(1-sulfanylbutyliden)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(1-mercaptobutylidene)-, diethyl ester [ACD/Index Name]
89745-59-5 [RN]
Diethyl (1-sulfanylbutylidene)propanedioate
PROPANEDIOIC ACID, (1-MERCAPTOBUTYLIDENE)-, DIETHYL ESTER

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 288.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.8±3.0 kJ/mol
Flash Point: 149.8±15.3 °C
Index of Refraction: 1.484
Molar Refractivity: 64.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 7.84
ACD/KOC (pH 5.5): 76.93
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.33
Polar Surface Area: 91 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 224.3±3.0 cm3

Click to predict properties on the Chemicalize site


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